3-[1-(4-chloranyl-2-fluoranyl-phenyl)-1-cyclopropyl-ethyl]-7-(methylsulfonylmethyl)-1H-indole

Systemtic Name: 3-[1-(4-chloranyl-2-fluoranyl-phenyl)-1-cyclopropyl-ethyl]-7-(methylsulfonylmethyl)-1H-indole Openeye Name: 3-[1-(4-chloro-2-fluoro-phenyl)-1-cyclopropyl-ethyl]-7-(methylsulfonylmethyl)-1H-indole CAS Name: 3-[1-(4-chloro-2-fluorophenyl)-1-cyclopropylethyl]-7-(methylsulfonylmethyl)-1H-indole IUPAC Name: 3-[1-(4-chloro-2-fluorophenyl)-1-cyclopropylethyl]-7-(methylsulfonylmethyl)-1H-indole Traditional Name: 3-[1-(4-chloro-2-fluoro-phenyl)-1-cyclopropyl-ethyl]-7-(mesylmethyl)-1H-indole Formula: C21H21ClFNO2S MolecularWeight: 405.913343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)(C2=C(C=C(C=C2)Cl)F)C3=CNC4=C3C=CC=C4CS(=O)(=O)C

Isomeric SMILES

CC(C1CC1)(C2=C(C=C(C=C2)Cl)F)C3=CNC4=C3C=CC=C4CS(=O)(=O)C

InChI

InChI=1S/C21H21ClFNO2S/c1-21(14-6-7-14,17-9-8-15(22)10-19(17)23)18-11-24-20-13(12-27(2,25)26)4-3-5-16(18)20/h3-5,8-11,14,24H,6-7,12H2,1-2H3